Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "4c69e80c92096785f6ffc886342f5c8b",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 40.875,
"b": 78.228,
"c": 80.861,
"alpha": 90.0,
"beta": 90.2,
"gamma": 90.0
},
"wavelengths": [1.09720],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [40.87,1.43],
"number_observations": 1760446,
"number_observations_unique": 87837,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.044
},
{
"type": "R(meas)",
"value": 0.045
},
{
"type": "R(pim)",
"value": 0.010
},
{
"type": "I/SigI",
"value": 27.0
},
{
"type": "Completeness",
"value": 93.7
},
{
"type": "Redundancy",
"value": 20.0
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.45,1.43],
"number_observations": 45075,
"number_observations_unique": 3041,
"quality_factors": [
{
"type": "R(merge)",
"value": 5.487
},
{
"type": "R(meas)",
"value": 5.681
},
{
"type": "R(pim)",
"value": 1.445
},
{
"type": "I/SigI",
"value": 0.5
},
{
"type": "Redundancy",
"value": 14.8
},
{
"type": "CC(1/2)",
"value": 0.392
}
]
}
]
}